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3-(2-Nitrobenzyliden)acetylacetone
SpectraBase Compound ID Bcwx8wlvzOO
InChI InChI=1S/C12H11NO4/c1-8(14)11(9(2)15)7-10-5-3-4-6-12(10)13(16)17/h3-7H,1-2H3
InChIKey AMQHJMLYYMZWGV-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BFa0gmamm
Name 3-(2-Nitrobenzyliden)acetylacetone
Alternate Name(s) 3-(2-nitrobenzylidene)pentane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO4
InChI InChI=1S/C12H11NO4/c1-8(14)11(9(2)15)7-10-5-3-4-6-12(10)13(16)17/h3-7H,1-2H3
InChIKey AMQHJMLYYMZWGV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19873290617
Molecular Weight 233.223 g/mol
SMILES CC(=O)C(C(=O)C)=Cc1c(cccc1)[N+](=O)[O-]
SPLASH splash10-00du-2900000000-8dc055a097a484b62b82
Source of Spectrum JF-329-1066-1f
Wiley ID 1791579